4-Nitrophenethyl alcohol
CAS No.:
100-27-6
M. Wt:
167.162
M. Fa:
C8H9NO3
InChI Key:
IKMXRUOZUUKSON-UHFFFAOYSA-N
Appearance:
Light yellow to Yellow powder to crystal
Names and Identifiers of 4-Nitrophenethyl alcohol
CAS Number |
100-27-6 |
|---|---|
EC Number |
202-835-8 |
MDL Number |
MFCD00010202 |
IUPAC Name |
2-(4-nitrophenyl)ethanol |
InChI |
InChI=1S/C8H9NO3/c10-6-5-7-1-3-8(4-2-7)9(11)12/h1-4,10H,5-6H2 |
InChIKey |
IKMXRUOZUUKSON-UHFFFAOYSA-N |
Canonical SMILES |
C1=CC(=CC=C1CCO)[N+](=O)[O-] |
UNSPSC Code |
12352100 |
Physical and chemical properties of 4-Nitrophenethyl alcohol
Acidity coefficient |
14.57±0.10(Predicted) |
|---|---|
Boiling Point |
351 °F at 16 mmHg (NTP, 1992) |
BRN |
1866148 |
Density |
1.3±0.1 g/cm3 |
Exact Mass |
167.058243 |
Flash Point |
144.5±9.4 °C |
Index of Refraction |
1.581 |
LogP |
1.09 |
Melting Point |
144 to 147 °F (NTP, 1992) |
Molecular Formula |
C8H9NO3 |
Molecular Weight |
167.162 |
PSA |
66.05000 |
Solubility |
less than 0.1 mg/mL at 64 °F (NTP, 1992) |
Stability |
Stable. Combustible. Incompatible with strong oxidizing agents, strong bases. |
Storage condition |
2-8°C |
Vapour Pressure |
0.0±0.6 mmHg at 25°C |
Water Solubility |
<0.01 g/100 mL at 18 ºC |
Safety Information of 4-Nitrophenethyl alcohol
Applications of 4-Nitrophenethyl alcohol
4-Nitrophenethyl alcohol finds applications in various fields:
- Pharmaceuticals: It serves as an intermediate in the synthesis of various pharmaceutical compounds.
- Dyes and Pigments: Its derivatives are used in dye manufacturing due to their vibrant colors.
- Chemical Research: The compound is utilized in laboratory research for studying reaction mechanisms and biological interactions.
Biological Activity of 4-Nitrophenethyl alcohol
Research indicates that 4-Nitrophenethyl alcohol exhibits certain biological activities. It has been studied for its potential antibacterial properties, although specific mechanisms of action remain under investigation. The presence of the nitro group is often associated with enhanced biological activity, making compounds like 4-Nitrophenethyl alcohol of interest in pharmacological studies.
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